N-(2-phenylsulfanylethyl)-4-(4-sulfamoylphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(2-phenylsulfanylethyl)-4-(4-sulfamoylphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-(2-phenylsulfanylethyl)-4-(4-sulfamoylphenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-[2-(phenylthio)ethyl]-4-(4-sulfamoylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(2-phenylsulfanylethyl)-4-(4-sulfamoylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-[2-(phenylthio)ethyl]-4-(4-sulfamoylphenyl)sulfonyl-piperazine-1-carboxamide Formula: C19H24N4O5S3 MolecularWeight: 484.61266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCCSC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1CN(CCN1C(=O)NCCSC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C19H24N4O5S3/c20-30(25,26)17-6-8-18(9-7-17)31(27,28)23-13-11-22(12-14-23)19(24)21-10-15-29-16-4-2-1-3-5-16/h1-9H,10-15H2,(H,21,24)(H2,20,25,26)